ethyl 4-[(2-sulfanylphenyl)carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[(2-sulfanylphenyl)carbamothioylamino]benzoate Openeye Name: ethyl 4-[(2-sulfanylphenyl)carbamothioylamino]benzoate CAS Name: 4-[[(2-mercaptoanilino)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-sulfanylphenyl)carbamothioylamino]benzoate Traditional Name: 4-[(2-mercaptophenyl)thiocarbamoylamino]benzoic acid ethyl ester Formula: C16H16N2O2S2 MolecularWeight: 332.44044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=CC=C2S

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=CC=C2S

InChI

InChI=1S/C16H16N2O2S2/c1-2-20-15(19)11-7-9-12(10-8-11)17-16(22)18-13-5-3-4-6-14(13)21/h3-10,21H,2H2,1H3,(H2,17,18,22)